ethyl (E)-3-[4-[3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoylamino]phenyl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[4-[3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoylamino]phenyl]prop-2-enoate Openeye Name: ethyl (E)-3-[4-[3-(3-oxo-1,4-benzothiazin-4-yl)propanoylamino]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[[1-oxo-3-(3-oxo-1,4-benzothiazin-4-yl)propyl]amino]phenyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[4-[3-(3-oxo-1,4-benzothiazin-4-yl)propanoylamino]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[3-(3-keto-1,4-benzothiazin-4-yl)propanoylamino]phenyl]acrylic acid ethyl ester Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC1=CC=C(C=C1)NC(=O)CCN2C(=O)CSC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)/C=C/C1=CC=C(C=C1)NC(=O)CCN2C(=O)CSC3=CC=CC=C32

InChI

InChI=1S/C22H22N2O4S/c1-2-28-22(27)12-9-16-7-10-17(11-8-16)23-20(25)13-14-24-18-5-3-4-6-19(18)29-15-21(24)26/h3-12H,2,13-15H2,1H3,(H,23,25)/b12-9+